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Methyl (E)-4,4-[(1R,2R)-1,2-dicyclohexylethylenedioxy]-2-pentenoate
SpectraBase Compound ID BhWHZjmkdVI
InChI InChI=1S/C20H32O4/c1-20(14-13-17(21)22-2)23-18(15-9-5-3-6-10-15)19(24-20)16-11-7-4-8-12-16/h13-16,18-19H,3-12H2,1-2H3/b14-13+/t18-,19-/m1/s1
InChIKey XSHSWZLULJOHEV-WKWPXIAWSA-N
Mol Weight 336.5 g/mol
Molecular Formula C20H32O4
Exact Mass 336.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmIYxkPPjx7
Name Methyl (E)-4,4-[(1R,2R)-1,2-dicyclohexylethylenedioxy]-2-pentenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O4
InChI InChI=1S/C20H32O4/c1-20(14-13-17(21)22-2)23-18(15-9-5-3-6-10-15)19(24-20)16-11-7-4-8-12-16/h13-16,18-19H,3-12H2,1-2H3/b14-13+/t18-,19-/m1/s1
InChIKey XSHSWZLULJOHEV-WKWPXIAWSA-N
Molecular Weight 336.472 g/mol
SMILES C(\C=C\C1(C)O[C@@]([C@](O1)(C1CCCCC1)[H])(C1CCCCC1)[H])(=O)OC
SPLASH splash10-0rta-2911000000-78f0934733722ead5c4d
Source of Spectrum KD-12-1751-7
Synonyms Methyl (2E)-3-[(4R,5R)-4,5-dicyclohexyl-2-methyl-1,3-dioxolan-2-yl]-2-propenoate
Wiley ID 1634536